NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 L 4.5131 8.1844 120.6267 54.3723 43.1017 176.0574 1 V 3.7755 8.1845 121.6635 62.5414 32.1918 174.4057 2 K 4.4903 8.8747 123.7673 56.1405 36.4812 174.4976 3 K 4.8392 8.0985 120.5194 54.5513 34.2120 174.5775 4 V 4.8438 8.5392 127.6469 61.2943 33.8698 174.0780 5 L 5.2009 8.9076 129.0033 53.1997 44.7966 174.6304 6 L 5.0238 9.1413 129.5531 54.2755 43.5679 175.0210 7 I 5.1123 8.9904 127.8138 59.6977 40.1199 174.2480 8 N 5.3516 9.1572 124.7084 51.7411 41.2453 175.5451 9 G 4.2349 9.0283 113.9701 43.9927 0.0000 171.1974 10 P 4.5019 0.0000 0.0000 64.3148 31.7188 176.1527 11 N 4.7112 9.4381 119.5718 54.2315 38.2387 176.6965 12 L 3.8659 7.2607 117.2994 57.4775 41.8665 179.0824 13 N 4.3539 8.0735 114.6454 55.2105 37.4274 175.7648 14 L 4.2461 8.5518 118.9825 55.3927 42.4963 176.6546 15 L 4.3779 7.6437 120.3801 55.0485 41.2861 176.5801 16 G 3.8472 7.8344 109.9679 44.6122 0.0000 173.4111 17 T 4.1746 8.6418 123.4768 64.2673 69.2873 176.7810 18 R 4.0607 7.8578 120.8456 58.5376 30.5519 176.5820 *23 Y 4.5364 7.6843 115.2383 56.5959 40.3813 174.4998 24 G 3.9535 7.5992 108.5161 44.8681 0.0000 176.4133 25 T 4.1923 8.1242 115.6571 61.0500 68.1208 174.4425 26 T 4.4175 9.5220 120.2526 63.7287 69.5741 175.5156 27 S 5.2581 8.5672 123.7215 56.1452 66.1360 174.9774 28 L 3.8414 8.2114 122.9090 58.3548 41.7720 178.4975 29 S 4.0549 8.0968 112.5068 61.6267 62.0674 175.8865 30 D 4.2917 8.1405 121.3237 57.4026 40.6893 178.6534 31 I 3.5671 7.4008 119.6808 64.4473 37.0022 178.3199 32 E 3.8547 7.9984 119.1028 59.4310 29.2252 179.3357 33 Q 3.9381 8.0302 117.7046 59.0084 28.7511 178.7581 34 A 3.9586 8.2450 121.6614 55.1772 18.2472 179.4209 35 A 3.9211 7.8504 118.8289 55.4824 18.6104 179.6179 36 I 3.6532 7.8996 118.4249 64.8292 37.2183 178.4527 37 E 3.9533 8.4169 119.2093 59.3952 28.8314 178.8499 38 Q 3.9514 8.2734 119.6984 59.4094 28.9927 178.9199 39 A 3.9919 7.7995 121.2741 55.0164 18.5100 179.3161 40 K 3.7859 7.7687 116.6515 59.9398 32.0591 179.1553 41 L 4.0285 8.1805 118.6326 57.4697 42.2939 178.3164 42 K 4.1038 7.9978 116.9852 56.9834 31.6465 178.1217 43 N 4.6354 8.5284 121.5622 53.7068 39.7558 174.1610 44 N 4.8916 7.7370 114.6023 52.7021 37.7456 175.1429 45 D 4.6485 8.4956 115.4473 55.8615 38.3974 174.7773 46 S 4.7079 7.5476 113.9345 58.8470 63.7955 173.3796 47 E 4.7075 9.1266 122.3385 54.9928 33.5365 173.9474 48 V 4.7405 8.3516 125.6299 61.2190 33.5751 174.8812 49 L 4.5836 8.7714 128.4328 54.2910 43.3746 176.4148 50 V 5.0622 8.2621 113.6803 59.8194 35.1396 174.8674 51 F 5.0128 9.3494 125.4049 56.9082 43.3977 172.9538 52 Q 5.4230 7.4045 124.2185 54.0084 31.7222 173.6525 53 S 4.7167 8.5311 119.7582 56.5929 65.4124 173.5751 54 N 4.4594 9.0018 121.4708 55.5637 39.1527 176.1024 55 T 4.3581 7.9143 115.9904 62.1380 69.6140 174.3014 56 E 3.5951 8.8732 127.2806 59.5199 29.4919 178.9176 57 G 3.6706 7.8547 104.6384 48.2061 0.0000 175.3217 58 F 4.8432 7.8785 119.6349 60.1521 38.9198 177.8263 59 I 3.9391 7.7828 119.3338 64.2363 37.0269 178.0629 60 I 3.5647 7.7833 120.7775 64.7521 36.9842 177.8957 61 D 4.2394 8.5777 119.6236 57.6071 40.5923 179.1566 62 R 3.6033 7.7697 118.8736 59.1888 29.4776 178.6428 63 I 3.6923 7.5586 119.8482 64.3545 37.1555 178.1434 64 H 4.3093 8.1309 117.3499 58.6670 28.3659 177.1292 65 E 3.8805 8.2684 121.0067 59.4830 29.3931 178.8383 66 A 3.9747 8.1582 120.6937 54.9821 18.3294 179.5766 67 K 3.9059 7.7569 116.9820 59.6383 32.1343 179.0676 68 R 4.0093 7.8215 117.3594 58.0935 29.8920 176.7188 69 Q 4.5396 7.3301 115.9792 55.6401 28.8176 175.5887 70 G 3.9092 8.3165 104.6578 47.1718 0.0000 174.7900 71 V 3.7129 8.3628 120.2386 62.7852 31.8216 175.8148 72 G 4.2133 8.6108 113.6133 45.3074 0.0000 172.8092 73 F 4.7596 7.3158 120.1789 57.4608 42.7425 172.4792 74 V 5.0457 8.2401 124.9713 61.1438 34.6381 174.0978 75 V 5.0534 8.9038 127.4364 61.2272 34.0690 174.0942 76 I 5.0794 8.9415 127.7061 59.5061 41.5973 173.1460 77 N 5.3173 9.6056 128.8162 51.2557 39.8452 174.7622 78 A 4.3826 8.7889 128.9173 51.7935 20.4875 178.4655 79 G 3.7314 8.1817 106.3730 45.9516 0.0000 176.3817 80 A 4.1467 8.6163 124.0215 55.4481 18.5223 179.4154 81 Y 4.8256 7.7789 113.4447 61.4905 37.7380 178.7273 82 T 4.1155 7.9162 116.6821 66.8179 68.3220 175.0567 83 H 5.0984 8.6026 115.7880 56.5086 29.3275 175.8469 84 T 4.6528 7.8137 107.6689 61.1221 70.5494 173.7198 85 S 4.6478 8.6565 117.1876 56.2286 61.6558 174.3237 86 V 3.2738 7.8318 128.6513 65.2539 31.3394 177.6240 87 G 3.6112 7.8563 105.2151 47.9240 0.0000 175.5376 88 I 3.6604 8.0245 122.3812 63.8766 37.0221 178.3521 89 R 3.7801 7.4163 119.1112 59.7722 29.9122 178.4413 90 D 4.4027 8.2032 118.0125 56.7823 40.6160 178.7543 91 A 3.9696 7.8380 121.7620 55.0812 18.5401 179.5277 92 L 3.8420 7.8150 117.4919 57.9332 41.4365 179.9256 93 L 4.1258 8.1081 118.0124 57.9028 41.7278 179.6414 94 G 3.7158 8.4825 104.8476 47.5198 0.0000 175.1172 95 T 4.0971 8.1835 110.1595 61.2185 69.7985 174.2395 96 A 3.6421 7.6392 123.2720 53.4902 16.3496 177.3701 97 I 4.5396 7.5849 121.1680 59.4706 39.0770 175.4468 98 P 4.3194 0.0000 0.0000 63.1639 32.3263 175.1080 99 F 5.1723 7.5300 114.4393 55.5910 41.8495 172.6980 100 I 4.8074 8.8155 120.6308 59.4988 40.0294 174.3435 101 E 4.7613 8.9304 128.5992 55.7471 30.4106 175.2040 102 V 4.4075 8.8657 127.5791 61.7082 34.2544 174.3392 103 H 4.8688 8.4939 123.0781 54.2326 31.6225 173.8384 104 I 3.9464 8.6515 125.4659 64.3920 37.7248 176.5593 105 T 4.4086 7.7608 108.8009 59.7434 70.9059 173.8413 106 N 4.6067 8.2724 120.2730 52.2284 38.1613 175.4553 107 V 3.5098 8.2152 120.5327 64.6183 31.8459 178.7352 108 H 4.4781 7.9114 115.3633 58.3746 28.6980 176.6226 109 Q 4.0974 8.0962 118.0438 58.0107 28.8510 176.2548 110 R 4.4161 7.7467 116.7760 54.4860 32.5234 175.6620 111 E 3.9476 8.2628 117.0328 56.7750 30.1653 176.5029 112 P 3.7487 0.0000 0.0000 65.4556 31.4018 178.7906 113 F 4.3913 8.2647 113.0424 60.0619 37.1501 176.9065 114 R 3.7169 6.9491 116.1537 57.2053 30.0906 177.7897 115 H 4.3168 8.0010 116.7944 57.4628 29.0564 175.7028 116 Q 4.3466 7.1596 118.1222 54.8938 29.5776 175.1554 117 S 4.8800 8.2146 115.7038 56.9055 65.2286 173.1022 118 Y 4.5437 9.1407 124.0252 58.4819 38.2294 176.0828 119 L 4.6735 7.8854 120.9395 56.4496 43.0901 178.6468 120 S 4.2915 9.2772 115.3180 61.1285 62.7433 176.2803 121 D 4.5567 8.1098 115.7115 54.4673 39.6135 176.6204 122 K 4.3606 8.1202 118.0788 56.0931 32.8497 176.0883 123 A 3.0693 7.1847 121.7524 50.7292 19.5793 178.2069 124 V 3.7464 7.7639 120.2063 65.7538 32.0034 175.9796 125 A 4.7413 7.4188 119.7333 50.6144 23.0337 175.1572 126 V 4.8162 8.0671 117.8709 60.2372 34.3378 174.7656 127 I 4.6592 8.3907 126.3397 59.3319 40.0775 174.7096 128 C 4.8111 8.7670 121.2651 58.5221 31.9743 173.9519 129 G 4.0285 8.8974 112.6621 45.4445 0.0000 172.9871 130 L 4.5341 7.8976 118.7417 53.7331 42.8633 178.4486 131 G 3.7785 7.7502 106.2884 46.1195 0.0000 176.4496 132 V 3.8236 8.4806 117.5877 65.9191 32.2213 177.8213 133 Y 4.4782 8.5348 120.3987 60.9426 38.2616 178.3454 134 G 3.5429 7.9032 106.5329 48.0026 0.0000 174.8753 135 Y 4.1668 7.6772 118.9639 61.2982 37.8947 179.0072 136 T 4.1302 8.2088 116.8660 66.1319 68.7015 176.3309 137 A 3.8144 7.7000 122.2364 54.7215 18.3188 179.2317 138 A 3.9236 7.9219 119.4171 55.7139 18.3506 180.0463 139 I 3.6634 7.8011 117.9699 64.4462 36.9662 178.3065 140 E 3.9264 8.1215 118.6684 59.7307 29.6080 178.6546 141 Y 4.0087 7.8340 118.7005 60.3279 38.8862 177.5234 142 A 2.7449 7.8674 121.6766 54.9080 18.2842 179.6752 143 L 4.0677 7.7556 115.3229 56.8201 41.6334 178.3995 144 N 4.7336 7.2468 114.3231 51.9677 39.4654 173.7859 145 Y 4.1356 7.3831 123.3921 56.7463 39.7558 174.8274 146 Q 4.5835 7.7472 125.6701 55.0679 29.8885 176.0029 147 L 4.2875 8.3988 119.8274 55.2876 41.6271 177.1512 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 0 L 8.18 4.51 0.00 1.64 1.66 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 1 V 8.18 3.78 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.31 0.00 0.00 2 K 8.87 4.49 0.00 1.71 1.97 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.35 7.81 3 K 8.10 4.84 0.00 1.82 1.70 0.00 1.72 0.00 0.00 1.93 0.00 0.00 2.82 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.43 7.81 4 V 8.54 4.84 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.93 0.00 0.00 5 L 8.91 5.20 0.00 1.80 1.53 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 6 L 9.14 5.02 0.00 1.84 1.58 1.23 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.99 5.11 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.67 1.06 0.00 0.00 8 N 9.16 5.35 0.00 2.71 2.74 0.00 0.00 6.46 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 G 9.03 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.50 0.00 1.89 1.88 0.00 3.81 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.44 0.00 11 N 9.44 4.71 0.00 2.91 3.02 0.00 0.00 7.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.26 3.87 0.00 2.03 1.78 1.06 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 13 N 8.07 4.35 0.00 2.77 3.08 0.00 0.00 6.08 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.55 4.25 0.00 2.08 1.74 0.91 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.64 4.38 0.00 1.83 1.81 0.99 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.83 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.64 4.17 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 18 R 7.86 4.06 0.00 1.80 2.00 0.00 3.31 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 *23 Y 7.68 4.54 0.00 3.06 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.60 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.12 4.19 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 26 T 9.52 4.42 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 27 S 8.57 5.26 0.00 4.03 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.21 3.84 0.00 1.92 1.66 0.83 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.10 4.05 0.00 3.89 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.14 4.29 0.00 2.87 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.40 3.57 1.72 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.12 0.05 0.00 0.00 32 E 8.00 3.85 0.00 2.10 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.54 0.00 33 Q 8.03 3.94 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 34 A 8.24 3.96 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.85 3.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 7.90 3.65 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.93 0.91 0.00 0.00 37 E 8.42 3.95 0.00 2.21 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 38 Q 8.27 3.95 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 39 A 7.80 3.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 K 7.77 3.79 0.00 1.97 1.90 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.47 1.55 7.81 41 L 8.18 4.03 0.00 1.68 1.72 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.00 4.10 0.00 2.01 1.82 0.00 1.83 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.76 1.58 7.81 43 N 8.53 4.64 0.00 2.82 2.97 0.00 0.00 6.98 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 7.74 4.89 0.00 2.88 2.94 0.00 0.00 7.10 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.50 4.65 0.00 2.86 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 S 7.55 4.71 0.00 3.96 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 9.13 4.71 0.00 2.01 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 48 V 8.35 4.74 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.95 0.00 0.00 49 L 8.77 4.58 0.00 1.69 1.60 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.26 5.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.95 0.00 0.00 51 F 9.35 5.01 0.00 3.02 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.40 5.42 0.00 1.92 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.07 0.00 53 S 8.53 4.72 0.00 4.07 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 N 9.00 4.46 0.00 2.79 2.87 0.00 0.00 6.94 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 7.91 4.36 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 56 E 8.87 3.60 0.00 1.16 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.78 0.00 57 G 7.85 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.88 4.84 0.00 3.30 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.78 3.94 2.10 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.01 1.00 0.00 0.00 60 I 7.78 3.56 1.95 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.80 0.76 0.00 0.00 61 D 8.58 4.24 0.00 2.84 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 7.77 3.60 0.00 1.00 1.59 0.00 2.66 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.33 0.00 63 I 7.56 3.69 1.92 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.90 0.91 0.00 0.00 64 H 8.13 4.31 0.00 3.15 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 E 8.27 3.88 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 66 A 8.16 3.97 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 7.76 3.91 0.00 1.87 1.80 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.57 7.81 68 R 7.82 4.01 0.00 2.08 1.94 0.00 3.25 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 69 Q 7.33 4.54 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.46 0.00 0.00 0.00 0.00 0.00 2.45 2.26 0.00 70 G 8.32 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.36 3.71 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.96 0.00 0.00 72 G 8.61 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 7.32 4.76 0.00 3.10 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.24 5.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.96 0.00 0.00 75 V 8.90 5.05 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.06 0.00 0.00 76 I 8.94 5.08 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.55 1.07 0.00 0.00 77 N 9.61 5.32 0.00 2.79 2.89 0.00 0.00 6.96 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.79 4.38 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.18 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.62 4.15 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Y 7.78 4.83 0.00 3.17 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.92 4.12 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 83 H 8.60 5.10 0.00 3.29 3.52 0.00 5.60 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.81 4.65 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 85 S 8.66 4.65 0.00 3.57 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.83 3.27 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.05 0.00 0.00 87 G 7.86 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.02 3.66 1.80 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.57 0.81 0.00 0.00 89 R 7.42 3.78 0.00 2.20 2.07 0.00 3.14 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 90 D 8.20 4.40 0.00 2.81 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.84 3.97 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.82 3.84 0.00 1.63 1.53 -0.08 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.11 4.13 0.00 1.66 1.75 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.48 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.18 4.10 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 96 A 7.64 3.64 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.58 4.54 1.86 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.67 0.89 0.00 0.00 98 P 0.00 4.32 0.00 0.89 1.83 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.98 0.00 99 F 7.53 5.17 0.00 3.11 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.82 4.81 2.04 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.94 0.90 0.00 0.00 101 E 8.93 4.76 0.00 2.21 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 102 V 8.87 4.41 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.72 0.00 0.00 103 H 8.49 4.87 0.00 3.07 3.23 0.00 5.71 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.65 3.95 1.94 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.95 0.99 0.00 0.00 105 T 7.76 4.41 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 106 N 8.27 4.61 0.00 2.79 2.78 0.00 0.00 6.86 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.22 3.51 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.60 0.00 0.00 108 H 7.91 4.48 0.00 3.12 3.29 0.00 5.70 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.10 4.10 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 110 R 7.75 4.42 0.00 1.77 1.69 0.00 3.13 0.00 0.00 3.13 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 111 E 8.26 3.95 0.00 1.40 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.37 0.00 112 P 0.00 3.75 0.00 2.14 2.09 0.00 3.58 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 113 F 8.26 4.39 0.00 3.24 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 6.95 3.72 0.00 1.41 1.62 0.00 2.82 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.50 0.00 115 H 8.00 4.32 0.00 3.11 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.16 4.35 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 117 S 8.21 4.88 0.00 3.87 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 9.14 4.54 0.00 3.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.89 4.67 0.00 1.87 2.08 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 120 S 9.28 4.29 0.00 3.87 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.11 4.56 0.00 2.80 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 K 8.12 4.36 0.00 2.00 1.98 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.61 7.81 123 A 7.18 3.07 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.76 3.75 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.70 0.00 0.00 125 A 7.42 4.74 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 8.07 4.82 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 1.02 0.00 0.00 127 I 8.39 4.66 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.96 0.84 0.00 0.00 128 C 8.77 4.81 0.00 2.97 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.90 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 7.90 4.53 0.00 1.61 1.69 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.75 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.48 3.82 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.06 0.00 0.00 133 Y 8.53 4.48 0.00 3.12 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.90 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Y 7.68 4.17 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 T 8.21 4.13 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 137 A 7.70 3.81 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.92 3.92 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 I 7.80 3.66 1.98 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.60 0.95 0.00 0.00 140 E 8.12 3.93 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 141 Y 7.83 4.01 0.00 3.11 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.87 2.74 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 L 7.76 4.07 0.00 1.66 1.71 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 144 N 7.25 4.73 0.00 2.55 2.67 0.00 0.00 6.90 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Y 7.38 4.14 0.00 3.05 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 Q 7.75 4.58 0.00 1.92 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.18 0.00 147 L 8.40 4.29 0.00 1.66 1.63 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.